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N-TRICHLOROETHOXYCARBONYL-3-O-(2-ACETAMIDO-3,4,6-TRI-O-ACETYL-2-DEOXY-ALPHA-D-GALACTOPYRANOSYL)-L-SERINE-BENZYLESTER
SpectraBase Compound ID IsHprD6Ri5h
InChI InChI=1S/C27H33Cl3N2O13/c1-14(33)31-21-23(44-17(4)36)22(43-16(3)35)20(12-39-15(2)34)45-25(21)41-11-19(32-26(38)42-13-27(28,29)30)24(37)40-10-18-8-6-5-7-9-18/h5-9,19-23,25H,10-13H2,1-4H3,(H,31,33)(H,32,38)/t19-,20-,21-,22+,23-,25+/m1/s1
InChIKey HGRAPRTXHKFIHX-FVIDMNLKSA-N
Mol Weight 699.9 g/mol
Molecular Formula C27H33Cl3N2O13
Exact Mass 698.104822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GWxJ0ACHxPM
Name N-TRICHLOROETHOXYCARBONYL-3-O-(2-ACETAMIDO-3,4,6-TRI-O-ACETYL-2-DEOXY-ALPHA-D-GALACTOPYRANOSYL)-L-SERINE-BENZYLESTER
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H33Cl3N2O13
InChI InChI=1S/C27H33Cl3N2O13/c1-14(33)31-21-23(44-17(4)36)22(43-16(3)35)20(12-39-15(2)34)45-25(21)41-11-19(32-26(38)42-13-27(28,29)30)24(37)40-10-18-8-6-5-7-9-18/h5-9,19-23,25H,10-13H2,1-4H3,(H,31,33)(H,32,38)/t19-,20-,21-,22+,23-,25+/m1/s1
InChIKey HGRAPRTXHKFIHX-FVIDMNLKSA-N
Literature Reference Author K.MIYAJIMA,T.NEKADO,K.IKEDA,K.ACHIWA
Literature Reference Citation CHEM.PHARM.BULL.,46,1676(1998)
Literature Reference DOI 10.1248/cpb.46.1676
Molecular Weight 699.924 g/mol
Solvent CDCl3
Source File Reference UWMS20768